Compound Identification
SMILES
FC1=CC(CC(=O)NC2CCC(CCN3CCC4=C(CC3)C=C(C=C4)C#N)CC2)=C(F)C=C1
InChIKey
InChIKey=KXFLBNGXWKPWCA-UHFFFAOYSA-N
Formula
C27H31F2N3O
Mass
451.562
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzazepines
Alternative Parents
Phenylacetamides Fluorobenzenes Azepines Aralkylamines Aryl fluorides Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Nitriles Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Phenylacetamide - Azepine - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Azacycle - Nitrile - Carbonitrile - Carboxylic acid derivative - Organooxygen compound - Cyanide - Organic oxide - Organohalogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzazepines. These are organic compounds containing a benzene ring fused to an azepine ring (unsaturated seven-membered heterocycle with one nitrogen atom replacing a carbon atom).
External Descriptors
Not available